2-azaspiro[3.4]octan-5-ol

C7H13NO — CID 147937126

IUPAC2-azaspiro[3.4]octan-5-ol
SMILESOC1CCCC12CNC2
InChIInChI=1S/C7H13NO/c9-6-2-1-3-7(6)4-8-5-7/h6,8-9H,1-5H2
InChIKeyILAAWAZCMRINDJ-UHFFFAOYSA-N
MW127.19 g/mol
LogP0.12
Rot. Bonds

About 2-azaspiro[3.4]octan-5-ol

2-azaspiro[3.4]octan-5-ol (PubChem CID 147937126) has the molecular formula C7H13NO and a molecular weight of 127.19 g/mol. Its IUPAC name is 2-azaspiro[3.4]octan-5-ol.

Molecular Properties

Compound Name2-azaspiro[3.4]octan-5-ol
PubChem CID147937126
Molecular FormulaC7H13NO
Molecular Weight127.19 g/mol
Exact Mass127.10
IUPAC Name2-azaspiro[3.4]octan-5-ol
SMILESOC1CCCC12CNC2
InChIInChI=1S/C7H13NO/c9-6-2-1-3-7(6)4-8-5-7/h6,8-9H,1-5H2
InChIKeyILAAWAZCMRINDJ-UHFFFAOYSA-N
XLogP0.12
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.19
LogP ≤ 50.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-azaspiro[3.4]octan-5-ol?
The IUPAC name of 2-azaspiro[3.4]octan-5-ol (CID 147937126) is 2-azaspiro[3.4]octan-5-ol.
What is the SMILES notation for 2-azaspiro[3.4]octan-5-ol?
The canonical SMILES for 2-azaspiro[3.4]octan-5-ol is OC1CCCC12CNC2.
What is the InChIKey of 2-azaspiro[3.4]octan-5-ol?
The InChIKey is ILAAWAZCMRINDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO/c9-6-2-1-3-7(6)4-8-5-7/h6,8-9H,1-5H2.
What are the key properties of 2-azaspiro[3.4]octan-5-ol?
2-azaspiro[3.4]octan-5-ol has a molecular weight of 127.19 g/mol, XLogP of 0.12, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-azaspiro[3.4]octan-5-ol is sourced from PubChem (CID 147937126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).